Molecule record

1-methoxypentane

C6H14O

102.18 g/mol

Loading structure

Molecular properties

Formula
C6H14O
Molar mass
102.18 g·mol−1
Exact mass
102.1045 Da
0
PubChem CID
69412

Functional groups

Alkane / alkyl carbon
Ether

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-methoxy-pentane
  • 1Methoxypentane
  • 628-80-8
  • 67412-13-9
  • Amyl methyl ether
  • BRN 1731334
  • Butane, methoxymethyl-
  • DTXCID70134381
Show all 24 synonyms
  • DTXSID40211890
  • Ether, methyl pentyl
  • Methyl amyl ether
  • Methyl pentyl ether
  • Pentane, 1-methoxy-
  • Pentane, 1-methoxy-(9CI)
  • Pentane, 1methoxy
  • Pentane, 1methoxy (9CI)
  • Pentyl methyl ether
  • RefChem:592690
  • SCHEMBL45576
  • methoxypentane
  • methyl n-pentyl ether
  • n-Amyl methyl ether
  • n-C5H11OCH3
  • nAmyl methyl ether

Structure identifiers

Canonical SMILES
CCCCCOC
Isomeric SMILES
CCCCCOC
InChI
InChI=1S/C6H14O/c1-3-4-5-6-7-2/h3-6H2,1-2H3
InChIKey
DBUJFULDVAZULB-UHFFFAOYSA-N
PubChem CID
69412

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1-methoxypentane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-methoxypentane; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record